[gmx-users] Monitor distance between atoms
Eric Smoll
ericsmoll at gmail.com
Wed Aug 27 20:01:54 CEST 2014
Hello Gromacs Users,
Is there a way to output the distance between and atom X and all atoms
within distance R of atom X along a trajectory?
I am paging through the manual but I can't seem to find anything like this.
I would settle for the coordinates of all atoms within a distance R of atom
X along the trajectory as well.
Best,
Eric
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